ethyl 3-(4-bromophenyl)-7-(2-methylprop-2-enoxy)-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: ethyl 3-(4-bromophenyl)-7-(2-methylprop-2-enoxy)-4-oxidanylidene-chromene-2-carboxylate Openeye Name: ethyl 3-(4-bromophenyl)-7-(2-methylallyloxy)-4-oxo-chromene-2-carboxylate CAS Name: 3-(4-bromophenyl)-7-(2-methylprop-2-enoxy)-4-oxo-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-bromophenyl)-7-(2-methylprop-2-enoxy)-4-oxochromene-2-carboxylate Traditional Name: 3-(4-bromophenyl)-4-keto-7-(2-methylallyloxy)chromene-2-carboxylic acid ethyl ester Formula: C22H19BrO5 MolecularWeight: 443.28726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=C)C)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=C)C)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H19BrO5/c1-4-26-22(25)21-19(14-5-7-15(23)8-6-14)20(24)17-10-9-16(11-18(17)28-21)27-12-13(2)3/h5-11H,2,4,12H2,1,3H3